DivK1c_005489
TL;DR: DivK1c_005489 (CAS 301694-54-2) is a chemical compound with molecular formula C22H23N3O6S2 and molecular weight 489.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-tert-butyl-4-methylphenoxy)-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]acetamide
Also Known As: DivK1c_005489, CDS1_004449, BIM-0030287.P001, 2-(2-tert-butyl-4-methylphenoxy)-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]acetamide, 2-(2-(tert-butyl)-4-methylphenoxy)-N-(5-((4-nitrophenyl)sulfonyl)thiazol-2-yl)acetamide
| Molecular Formula | C22H23N3O6S2 |
|---|---|
| Molecular Weight | 489.10 g/mol |
| LogP | 4.50752 |
| Topological Polar Surface Area | 128.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 489.1028 |
| Heavy Atoms | 33 |
| Complexity | 1292.4105 |
Chemical Identifiers
| CAS Number | 301694-54-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)OCC(=O)NC2=NC=C(S2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(C)(C)C |
Product Overview
DivK1c_005489 (CAS 301694-54-2), with molecular formula C22H23N3O6S2 and molecular weight 489.10 g/mol. IUPAC: 2-(2-tert-butyl-4-methylphenoxy)-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]acetamide.
Chemical Property Profile of DivK1c_005489
Property Insights of DivK1c_005489
The XLogP value of 4.50752 indicates that DivK1c_005489 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.5 Ų falls within the moderate polarity range, balancing permeability and solubility for DivK1c_005489. Following Lipinski's Rule of Five, DivK1c_005489 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of DivK1c_005489?
The CAS number of DivK1c_005489 is 301694-54-2.
What is the molecular formula of DivK1c_005489?
The molecular formula of DivK1c_005489 is C22H23N3O6S2.
What is the molecular weight of DivK1c_005489?
The molecular weight of DivK1c_005489 is 489.10 g/mol.
Where can I buy DivK1c_005489?
You can request a quote for DivK1c_005489 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DivK1c_005489?
Yes, KEHONG BIO provides custom synthesis services for DivK1c_005489 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.